1
0
mirror of https://github.com/TREX-CoE/qmckl.git synced 2024-07-18 00:43:51 +02:00

Jastrow implementation via dgemm (#57)

* Added chameleon support.

* Started work on tmp_c.

* Added initial implementation of dtmp_c.

* Jastrow een and een_deriv_e can now use tmp_c and dtmp_c.

* Correct indexing. Still testing.

* Fixed a bug in call to provide_dtmp_c.

* Added test for tmp_c.

* Using dtmp_c for een_deriv_e. All tests pass.

* Added final test for dtmp_c. All tests passing. Ready for merge.
This commit is contained in:
vijay 2022-01-21 08:52:02 +01:00 committed by GitHub
parent 18f9f96bcc
commit 61e09a7870
No known key found for this signature in database
GPG Key ID: 4AEE18F83AFDEB23

File diff suppressed because it is too large Load Diff